Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.60 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | HPGD | P15428 | 2/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.55 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.53 |
| ▸ | CA12 | O43570 | 2/20 | 0.49 |
| ▸ | CA1 | P00915 | 2/20 | 0.49 |
| ▸ | CA2 | P00918 | 2/20 | 0.49 |
| ▸ | CA7 | P43166 | 2/20 | 0.49 |
| ▸ | CA9 | Q16790 | 2/20 | 0.49 |
| ▸ | HTR1A | P08908 | 2/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.47 |
| ▸ | DRD1 | P21728 | 2/20 | 0.47 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.47 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL13220450 | 0.79 | KDM4E (0.59) | KDM4EALDH1A1TSHRSMN1; SMN2LMNA | |
| SCHEMBL11685896 | 0.79 | TSHR (0.63) | KDM4EALDH1A1TSHRSMN1; SMN2LMNA | |
| SCHEMBL7817206 | 0.78 | KDM4E (0.88) | KDM4EALDH1A1TSHRSMN1; SMN2LMNA | |
| SCHEMBL11737080 | 0.77 | KDM4E (0.56) | KDM4EALDH1A1TSHRSMN1; SMN2LMNA | |
| SCHEMBL11451997 | 0.77 | KDM4E (0.75) | KDM4EALDH1A1TSHRSMN1; SMN2LMNA | |
| SCHEMBL11729428 | 0.76 | ADORA3 (0.68) | KDM4EALDH1A1TSHRSMN1; SMN2LMNA | |
| SCHEMBL7368284 | 0.76 | KDM4E (1.00) | KDM4EALDH1A1TSHRSMN1; SMN2LMNA | |
| SCHEMBL11452241 | 0.75 | ABCC1 (0.74) | KDM4EALDH1A1TSHRSMN1; SMN2LMNA | |
| SCHEMBL11452070 | 0.75 | ADORA3 (0.67) | KDM4EALDH1A1TSHRSMN1; SMN2LMNA | |
| SCHEMBL11524111 | 0.75 | KDM4E (0.81) | KDM4EALDH1A1TSHRSMN1; SMN2LMNA |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4020178-A | 1,4-Dihydropyridine esters used as coronary dilators and anti-hypertensives | BAYER AKTIENGESELLSCHAFT (DT) | 1977-04-26 | — | — | US | claimed |
| US-3971796-A | 1,4-Dihydropyridine esters | BAYER AKTIENGESELLSCHAFT (DT) | 1976-07-27 | — | — | US | claimed |
| US-4020178-A | 1,4-Dihydropyridine esters used as coronary dilators and anti-hypertensives | BAYER AKTIENGESELLSCHAFT (DT) | 1977-04-26 | — | — | US | disclosed |
| US-3974278-A | 1,4-Dihydropyridine esters | BAYER AKTIENGESELLSCHAFT (DT) | 1976-08-10 | — | — | US | disclosed |